Crystallography Open Database

Information card for entry 4114605

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Coordinates	4114605.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23.5 H22 N4 Pt
Calculated formula	C23.5 H22 N4 Pt
Title of publication	Synthesis and Characterization of Pt(CN-p-(C2H5)C6H4)2(CN)2, a Crystalline Vapoluminescent Compound That Detects Vapor-Phase Aromatic Hydrocarbons
Authors of publication	Carrie E. Buss; Kent R. Mann
Journal of publication	Journal of the American Chemical Society
Year of publication	2002
Journal volume	124
Pages of publication	1031 - 1039
a	19.894 ± 0.001 Å
b	18.365 ± 0.001 Å
c	13.15 ± 0.001 Å
α	90 ± 0.001°
β	118.127 ± 0.001°
γ	90 ± 0.001°
Cell volume	4237 ± 0.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0715
Residual factor for significantly intense reflections	0.0328
Weighted residual factors for significantly intense reflections	0.0687
Weighted residual factors for all reflections included in the refinement	0.0792
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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